SCHEMBL18828889

SCHEMBL18828889

CCCCCCCCc1ccc2c(c1)c1cc3c4cc(-c5ccccc5)c(-c5ccccc5)cc4c3cc21

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.48
RORA P35398 1/20 0.47
RORC P51449 1/20 0.47
RORB Q92753 1/20 0.47
PSMB5 P28074 1/20 0.47
HSD11B1 P28845 1/20 0.46
HTR2A P28223 1/20 0.43
RARB P10826 2/20 0.43
KAT8 Q9H7Z6 2/20 0.42
PPARA Q07869 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31236768 0.85 RORA (0.58) GPR3RORARORCRORBHTR2A
SCHEMBL9165312 0.85 RORA (0.58) GPR3RORARORCRORBHTR2A
SCHEMBL6737401 0.82 HSD17B10 (0.55) HTR2ARARB
SCHEMBL196244 0.82 HSD17B10 (0.55) HTR2ARARB
SCHEMBL20274701 0.78 RORA (0.50) GPR3RORARORCRORBPSMB5
SCHEMBL27643186 0.78 PSMB5 (0.52) GPR3PSMB5HSD11B1HTR2ARARB
SCHEMBL9797528 0.78 RARB (0.62) GPR3PSMB5HSD11B1HTR2ARARB
SCHEMBL7443234 0.78 PSMB5 (0.52) GPR3PSMB5HSD11B1HTR2ARARB
SCHEMBL5371426 0.78 HSD11B1 (0.48) GPR3RORARORCRORBPSMB5
SCHEMBL9825790 0.78 GPR3 (0.50) GPR3RORARORCRORBPSMB5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1867623-B1 TERPHENYLENE DERIVATIVES, TETRAHALOTERPHENYL DERIVATIVES AND PROCESSES FOR THE PRODUCTION OF BOTH TOSOH CORP (JP) 2017-05-10 EP disclosed